2-[1-(4-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylethanoic acid

Systemtic Name: 2-[1-(4-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylethanoic acid Openeye Name: 2-[2,5-dioxo-1-(p-tolyl)pyrrolidin-3-yl]sulfanylacetic acid CAS Name: 2-[[1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]acetic acid IUPAC Name: 2-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylacetic acid Traditional Name: 2-[[2,5-diketo-1-(p-tolyl)pyrrolidin-3-yl]thio]acetic acid Formula: C13H13NO4S MolecularWeight: 279.31162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)CC(C2=O)SCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)CC(C2=O)SCC(=O)O

InChI

InChI=1S/C13H13NO4S/c1-8-2-4-9(5-3-8)14-11(15)6-10(13(14)18)19-7-12(16)17/h2-5,10H,6-7H2,1H3,(H,16,17)